%chk=000298697.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298697

0 1
O 7.074896 0.229574 0.145127
O -7.073525 -0.231264 0.144614
N 0.669936 -0.109912 0.005918
N -0.668314 0.109266 0.004995
C 9.216559 -0.352778 -0.583382
C -9.215208 0.348998 -0.585530
C 7.735062 -0.572216 -0.886784
C -7.733687 0.570134 -0.887603
C 5.704598 0.260890 0.166893
C -5.703230 -0.261362 0.167375
C 10.092986 -1.118120 -1.566528
C -10.091625 1.113601 -1.569260
C 2.943675 0.516172 0.460765
C -2.942223 -0.514122 0.463288
C 5.192002 1.069861 1.206413
C -5.190650 -1.070467 1.206798
C 4.859587 -0.416302 -0.721709
C -4.858156 0.417163 -0.720155
C 3.817239 1.190734 1.342102
C -3.815879 -1.190050 1.343514
C 3.477959 -0.281029 -0.563936
C -3.476529 0.283099 -0.561406
C 1.491049 0.676362 0.644310
C -1.489634 -0.672971 0.648095
H 9.432000 -0.664314 0.459610
H 9.445261 0.732576 -0.616005
H -9.431896 0.660051 0.457347
H -9.442686 -0.736601 -0.618599
H 7.437937 -0.186154 -1.875670
H 7.423895 -1.623067 -0.768109
H -7.435330 0.184704 -1.876367
H -7.423779 1.621287 -0.768313
H 9.911977 -2.198690 -1.521180
H 11.156529 -0.959167 -1.347467
H 9.924923 -0.796346 -2.601274
H -9.911810 2.194355 -1.523546
H -11.155181 0.953467 -1.351127
H -9.922347 0.792213 -2.603929
H 5.882138 1.579251 1.874737
H -5.880809 -1.580988 1.874237
H 5.250484 -1.036171 -1.520847
H -5.249015 1.037112 -1.519253
H 3.409846 1.812940 2.139979
H -3.408536 -1.812397 2.141315
H 2.802860 -0.803214 -1.248835
H -2.801424 0.806225 -1.245593
H 1.188617 1.475595 1.339820
H -1.187243 -1.467827 1.348653


%chk=000298697-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298697

0 1
O 7.172270 0.659044 -0.251278
O -7.170883 -0.659876 -0.251662
N 0.693104 -0.181010 -0.251700
N -0.691717 0.180186 -0.251986
C 9.397348 -0.292053 -0.250293
C -9.395960 0.291221 -0.251412
C 7.903618 -0.624415 -0.250900
C -7.902230 0.623582 -0.252345
C 5.774101 0.623328 -0.251344
C -5.772714 -0.624159 -0.251600
C 10.262016 -1.572031 -0.250285
C -10.260628 1.571200 -0.252244
C 2.933445 0.774437 -0.251598
C -2.932058 -0.775262 -0.251349
C 5.131570 1.888338 -0.251409
C -5.130181 -1.889167 -0.250395
C 4.998945 -0.569630 -0.251411
C -4.997561 0.568800 -0.252708
C 3.730015 1.957384 -0.251555
C -3.728625 -1.958210 -0.250294
C 3.595572 -0.485875 -0.251463
C -3.594188 0.485048 -0.252502
C 1.475405 0.885070 -0.251690
C -1.474018 -0.885893 -0.251127
H 9.625658 0.325088 0.638395
H 9.626243 0.325460 -1.138575
H -9.624204 -0.325286 0.637733
H -9.624922 -0.326924 -1.139236
H 7.626844 -1.209114 -1.153010
H 7.625996 -1.209046 0.650995
H -7.625480 1.207526 -1.154952
H -7.624583 1.208967 0.649052
H 10.063637 -2.192748 0.643612
H 11.336265 -1.317092 -0.249812
H 10.064313 -2.192292 -1.144648
H -10.062182 2.192539 0.641205
H -11.334877 1.316261 -0.251517
H -10.062991 2.190837 -1.147054
H 5.750589 2.790407 -0.251377
H -5.749198 -2.791237 -0.249580
H 5.479512 -1.552307 -0.251449
H -5.478130 1.551476 -0.253757
H 3.237611 2.937540 -0.251649
H -3.236220 -2.938364 -0.249385
H 2.982617 -1.393047 -0.251497
H -2.981235 1.392221 -0.253326
H 1.031579 1.897325 -0.251852
H -1.030191 -1.898147 -0.250267


